[2-oxidanylidene-2-(pyridin-1-ium-4-ylamino)ethyl]azanium dichloride

Systemtic Name: [2-oxidanylidene-2-(pyridin-1-ium-4-ylamino)ethyl]azanium dichloride Openeye Name: [2-oxo-2-(pyridin-1-ium-4-ylamino)ethyl]ammonium dichloride CAS Name: [2-oxo-2-(4-pyridin-1-iumylamino)ethyl]ammonium dichloride IUPAC Name: [2-oxo-2-(pyridin-1-ium-4-ylamino)ethyl]azanium dichloride Traditional Name: [2-keto-2-(pyridin-1-ium-4-ylamino)ethyl]ammonium dichloride Formula: C7H11Cl2N3O MolecularWeight: 224.08774

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Descriptors Computed from Structure

Canonical SMILES:

C1=C[NH+]=CC=C1NC(=O)C[NH3+].[Cl-].[Cl-]

Isomeric SMILES

C1=C[NH+]=CC=C1NC(=O)C[NH3+].[Cl-].[Cl-]

InChI

InChI=1S/C7H9N3O.2ClH/c8-5-7(11)10-6-1-3-9-4-2-6;;/h1-4H,5,8H2,(H,9,10,11);2*1H